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4-(hydroxymethyl)-1-naphthalenecarbonitrile
SpectraBase Compound ID 1xBgSLTcmeB
InChI InChI=1S/C12H9NO/c13-7-9-5-6-10(8-14)12-4-2-1-3-11(9)12/h1-6,14H,8H2
InChIKey PZKDOSHWQBLVJW-UHFFFAOYSA-N
Mol Weight 183.21 g/mol
Molecular Formula C12H9NO
Exact Mass 183.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Rcnlibzqat
Name 4-(hydroxymethyl)-1-naphthalenecarbonitrile
CAS Registry Number 79996-90-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9NO
InChI InChI=1S/C12H9NO/c13-7-9-5-6-10(8-14)12-4-2-1-3-11(9)12/h1-6,14H,8H2
InChIKey PZKDOSHWQBLVJW-UHFFFAOYSA-N
Molecular Weight 183.210 g/mol
SMILES OCc1c2c(c(C#N)cc1)cccc2
SPLASH splash10-0f89-0900000000-b3b4e7678668f9f736dd
Source of Spectrum I-59-2636-0
Synonyms 4-(hydroxymethyl)-1-naphthonitrile 4-(hydroxymethyl)naphthalene-1-carbonitrile 4-Methylolnaphthalene-1-carbonitrile
Wiley ID 1179850